| CAS Number | 331647-95-1 |
| Catalog Number | AG00I6F5(AGN-PC-0WBA4X) |
| Chemical Name | Methyl pyrazolo[1,5-a]pyrimidine-2-carboxylate |
| IUPAC Name | methyl pyrazolo[1,5-a]pyrimidine-2-carboxylate |
| InChI | InChI=1S/C8H7N3O2/c1-13-8(12)6-5-7-9-3-2-4-11(7)10-6/h2-5H,1H3 |
| InChI Key | QNHIYHPRBVBSBQ-UHFFFAOYSA-N |
| MDL Number | MFCD00297333 |
| Molecular Formula | C8H7N3O2 |
| Molecular Weight | 177.1601 |
| SMILES | O=C(C1=NN2C=CC=NC2=C1)OC |
| Synonyms | methyl pyrazolo[1,5-a]pyrimidine-2-carboxylate,
331647-95-1,
methyl 8-hydropyrazolo[1,5-a]pyrimidine-2-carboxylate,
SCHEMBL4250069,
CTK6J1331,
DTXSID90598880,
ZINC2565205,
MFCD00297333,
SBB022200,
STK349652,
AKOS000310290,
MCULE-3376814789,
PB24653,
AJ-41105,
AS-50405,
CS-0054858,
ST45137681,
Q-2102,
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| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.163g/mol |
| Monoisotopic Mass | 177.054g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 56.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number